SCHEMBL10000580

SCHEMBL10000580

CC1(C)c2cc(-c3ccccc3)cnc2-c2c1cc1ccccc1c2O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
IDO1 P14902 2/20 0.38
TDO2 P48775 2/20 0.38
CTDSP1 Q9GZU7 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
MPI P34949 1/20 0.33
KMT2A Q03164 1/20 0.33
NQO1 P15559 1/20 0.33
PDK2 Q15119 1/20 0.33
DHODH Q02127 1/20 0.33
PARP1 P09874 1/20 0.33
PSMB5 P28074 1/20 0.33
TAAR1 Q96RJ0 2/20 0.32
ESR1 P03372 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10000576 0.86 PSMB5 (0.36) KDM4EIDO1TDO2CTDSP1TDP1
SCHEMBL10028258 0.83 IDO1 (0.41) IDO1TDO2CTDSP1TDP1ALDH1A1
SCHEMBL10000559 0.79 PDK2 (0.38) KDM4ETDP1MEN1ALDH1A1MAPT
SCHEMBL10000568 0.78 NQO1 (0.35) KDM4EIDO1TDO2MEN1KMT2A
SCHEMBL10000570 0.78 KMT2A (0.43) KDM4ETDP1MEN1ALDH1A1MAPT
SCHEMBL22910049 0.73 MEN1 (0.44) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL10000594 0.71 CA12 (0.38) KDM4EIDO1TDO2MEN1MAPT
SCHEMBL80941 0.69 PDK2 (0.45) KDM4ETDP1MEN1ALDH1A1MAPT
SCHEMBL10000597 0.68 PDK2 (0.36) KDM4EMAPTKMT2APDK2
SCHEMBL21577060 0.68 PDK2 (0.33) IDO1TDO2MEN1ALDH1A1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 US disclosed
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 KDM4E 3600/4885IDO1 2635/4885TDO2 2079/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 KDM4E 3600/4885IDO1 2635/4885TDO2 2079/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.